## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
1 |
|
I |
219 |
64 |
12552 |
◊ |
M |
x,y,z |
1_555 |
214 |
61 |
11611 |
1986.1 |
-28.8 |
0.041 |
11 |
1 |
0 |
0.444 |
2 |
|
H |
195 |
55 |
12554 |
◊ |
L |
x,y,z |
1_555 |
192 |
58 |
11787 |
1801.1 |
-24.9 |
0.048 |
13 |
1 |
0 |
0.444 |
Average: |
1893.6 |
-26.9 |
0.045 |
12 |
1 |
0 |
0.444 |
2 |
3 |
|
I |
39 |
12 |
12552 |
◊ |
H |
x-1/2,y+3/2,z-1 |
3_464 |
46 |
13 |
12554 |
386.4 |
-0.3 |
0.699 |
3 |
0 |
0 |
0.000 |
3 |
4 |
|
H |
47 |
14 |
12554 |
◊ |
M |
-x+3/2,y-1/2,-z+1 |
4_646 |
47 |
14 |
11611 |
368.3 |
0.3 |
0.747 |
11 |
5 |
0 |
0.033 |
4 |
5 |
|
I |
37 |
10 |
12552 |
◊ |
H |
x-1/2,y+1/2,z-1 |
3_454 |
39 |
11 |
12554 |
365.7 |
-0.2 |
0.775 |
8 |
0 |
0 |
0.000 |
5 |
6 |
|
L |
37 |
9 |
11787 |
◊ |
H |
-x+3/2,y-1/2,-z+2 |
4_647 |
36 |
9 |
12554 |
331.9 |
4.4 |
0.935 |
9 |
3 |
0 |
0.000 |
6 |
7 |
|
L |
41 |
14 |
11787 |
◊ |
I |
-x+3/2,y-1/2,-z+1 |
4_646 |
45 |
13 |
12552 |
324.4 |
0.8 |
0.792 |
3 |
1 |
0 |
0.004 |
7 |
8 |
|
I |
37 |
14 |
12552 |
◊ |
M |
x,y-1,z |
1_545 |
32 |
10 |
11611 |
305.4 |
-1.3 |
0.603 |
4 |
0 |
0 |
0.000 |
8 |
9 |
|
I |
36 |
10 |
12552 |
◊ |
L |
x,y,z |
1_555 |
29 |
9 |
11787 |
281.0 |
-3.2 |
0.381 |
3 |
0 |
0 |
0.028 |
9 |
10 |
|
L |
24 |
9 |
11787 |
◊ |
H |
x,y-1,z |
1_545 |
22 |
10 |
12554 |
202.4 |
-0.8 |
0.571 |
2 |
0 |
0 |
0.000 |
10 |
11 |
|
H |
22 |
9 |
12554 |
◊ |
M |
x,y,z |
1_555 |
19 |
6 |
11611 |
157.9 |
-1.4 |
0.492 |
0 |
0 |
0 |
0.009 |
11 |
12 |
|
L |
16 |
5 |
11787 |
x |
L |
-x+3/2,y-1/2,-z+2 |
4_647 |
13 |
5 |
11787 |
143.4 |
-0.6 |
0.508 |
1 |
2 |
0 |
0.000 |
12 |
13 |
|
I |
22 |
9 |
12552 |
◊ |
I |
-x+1,y,-z+1 |
2_656 |
22 |
9 |
12552 |
141.2 |
0.6 |
0.845 |
2 |
0 |
0 |
0.003 |
13 |
14 |
|
L |
18 |
6 |
11787 |
◊ |
M |
x,y-1,z |
1_545 |
15 |
5 |
11611 |
135.9 |
2.2 |
0.854 |
1 |
0 |
0 |
0.000 |
14 |
15 |
|
I |
14 |
6 |
12552 |
◊ |
L |
x-1/2,y+1/2,z-1 |
3_454 |
13 |
4 |
11787 |
130.2 |
-0.5 |
0.573 |
0 |
0 |
0 |
0.000 |
16 |
|
M |
12 |
3 |
11611 |
◊ |
H |
x-1/2,y+1/2,z-1 |
3_454 |
14 |
6 |
12554 |
121.3 |
-1.4 |
0.424 |
0 |
0 |
0 |
0.000 |
Average: |
125.7 |
-0.9 |
0.498 |
0 |
0 |
0 |
0.000 |
15 |
17 |
|
M |
21 |
5 |
11611 |
◊ |
H |
x-1/2,y+3/2,z-1 |
3_464 |
10 |
4 |
12554 |
117.8 |
-1.0 |
0.502 |
1 |
0 |
0 |
0.000 |
16 |
18 |
|
L |
16 |
5 |
11787 |
◊ |
M |
-x+3/2,y-1/2,-z+1 |
4_646 |
12 |
4 |
11611 |
103.5 |
-0.7 |
0.482 |
1 |
0 |
0 |
0.007 |
17 |
19 |
|
[SO4]M:218 |
5 |
1 |
185 |
f |
M |
x,y,z |
1_555 |
10 |
4 |
11611 |
92.3 |
-13.2 |
0.693 |
3 |
0 |
0 |
0.189 |
18 |
20 |
|
M |
8 |
4 |
11611 |
◊ |
L |
x-1/2,y+3/2,z-1 |
3_464 |
13 |
5 |
11787 |
90.2 |
1.3 |
0.806 |
1 |
0 |
0 |
0.000 |
19 |
21 |
|
[SO4]M:217 |
5 |
1 |
186 |
f |
M |
x,y,z |
1_555 |
13 |
4 |
11611 |
90.2 |
-13.1 |
0.853 |
6 |
0 |
0 |
0.205 |
22 |
|
[SO4]L:217 |
5 |
1 |
185 |
f |
L |
x,y,z |
1_555 |
11 |
4 |
11787 |
84.0 |
-11.2 |
0.928 |
5 |
0 |
0 |
0.205 |
Average: |
87.1 |
-12.1 |
0.890 |
6 |
0 |
0 |
0.205 |
20 |
23 |
|
L |
12 |
5 |
11787 |
f |
[SO4]I:226 |
-x+3/2,y-1/2,-z+1 |
4_646 |
5 |
1 |
186 |
78.9 |
-11.7 |
0.812 |
6 |
0 |
0 |
0.206 |
21 |
24 |
|
I |
5 |
1 |
12552 |
◊ |
H |
x,y,z |
1_555 |
17 |
7 |
12554 |
78.8 |
0.7 |
0.773 |
1 |
1 |
0 |
0.000 |
22 |
25 |
|
[SO4]I:228 |
5 |
1 |
185 |
f |
I |
x,y,z |
1_555 |
10 |
5 |
12552 |
77.3 |
-10.9 |
0.822 |
4 |
0 |
0 |
0.284 |
23 |
26 |
|
[SO4]L:218 |
5 |
1 |
185 |
f |
L |
x,y,z |
1_555 |
8 |
4 |
11787 |
74.9 |
-9.6 |
0.877 |
3 |
0 |
0 |
0.157 |
24 |
27 |
|
M |
8 |
3 |
11611 |
◊ |
L |
x,y,z |
1_555 |
7 |
2 |
11787 |
71.5 |
-1.5 |
0.209 |
0 |
0 |
0 |
0.009 |
25 |
28 |
|
[SO4]I:226 |
5 |
1 |
186 |
◊ |
I |
x,y,z |
1_555 |
10 |
5 |
12552 |
68.2 |
-8.4 |
0.869 |
3 |
0 |
0 |
0.060 |
26 |
29 |
|
[SO4]I:227 |
5 |
1 |
185 |
◊ |
I |
-x+1,y,-z+1 |
2_656 |
12 |
4 |
12552 |
56.3 |
-7.4 |
0.813 |
3 |
0 |
0 |
0.196 |
27 |
30 |
|
[SO4]I:227 |
5 |
1 |
185 |
◊ |
I |
x,y,z |
1_555 |
11 |
4 |
12552 |
55.8 |
-7.4 |
0.839 |
5 |
0 |
0 |
0.216 |
28 |
31 |
|
[SO4]I:228 |
4 |
1 |
185 |
◊ |
I |
-x+1,y,-z+1 |
2_656 |
6 |
3 |
12552 |
52.9 |
-6.1 |
0.953 |
3 |
0 |
0 |
0.167 |
29 |
32 |
|
[SO4]L:217 |
4 |
1 |
185 |
◊ |
I |
x,y,z |
1_555 |
8 |
3 |
12552 |
52.6 |
-6.1 |
0.798 |
1 |
0 |
0 |
0.040 |
30 |
33 |
|
[SO4]I:227 |
5 |
1 |
185 |
f |
[SO4]I:227 |
-x+1,y,-z+1 |
2_656 |
5 |
1 |
185 |
52.1 |
-11.3 |
0.993 |
0 |
0 |
0 |
0.127 |
31 |
34 |
|
L |
5 |
2 |
11787 |
◊ |
M |
-x+3/2,y-1/2,-z+2 |
4_647 |
5 |
2 |
11611 |
40.8 |
0.5 |
0.752 |
1 |
0 |
0 |
0.000 |
32 |
35 |
|
L |
5 |
1 |
11787 |
◊ |
M |
-x+1,y-1,-z+1 |
2_646 |
4 |
1 |
11611 |
37.1 |
0.4 |
0.704 |
0 |
0 |
0 |
0.000 |
33 |
36 |
|
[SO4]L:218 |
3 |
1 |
185 |
◊ |
H |
-x+3/2,y-1/2,-z+2 |
4_647 |
4 |
2 |
12554 |
26.0 |
-3.1 |
0.903 |
1 |
0 |
0 |
0.000 |
34 |
37 |
|
[SO4]L:217 |
4 |
1 |
185 |
◊ |
M |
x,y,z |
1_555 |
2 |
1 |
11611 |
19.9 |
-2.1 |
0.723 |
0 |
0 |
0 |
0.013 |
35 |
38 |
|
I |
1 |
1 |
12552 |
◊ |
M |
-x+1,y,-z+1 |
2_656 |
2 |
1 |
11611 |
15.7 |
-0.5 |
0.217 |
0 |
0 |
0 |
0.005 |
36 |
39 |
|
L |
3 |
1 |
11787 |
◊ |
[SO4]M:217 |
-x+3/2,y-1/2,-z+2 |
4_647 |
2 |
1 |
186 |
13.8 |
-1.7 |
0.736 |
0 |
0 |
0 |
0.000 |
37 |
40 |
|
I |
3 |
2 |
12552 |
◊ |
L |
x-1/2,y+3/2,z-1 |
3_464 |
1 |
1 |
11787 |
6.8 |
0.3 |
0.778 |
0 |
0 |
0 |
0.000 |
38 |
41 |
|
M |
2 |
2 |
11611 |
◊ |
M |
-x+1,y,-z+1 |
2_656 |
2 |
2 |
11611 |
1.6 |
-0.0 |
0.603 |
0 |
0 |
0 |
0.000 |
39 |
42 |
|
[SO4]I:228 |
1 |
1 |
185 |
◊ |
[SO4]I:227 |
-x+1,y,-z+1 |
2_656 |
1 |
1 |
185 |
1.2 |
-0.3 |
1.000 |
0 |
0 |
0 |
0.006 |
40 |
43 |
|
[SO4]M:217 |
1 |
1 |
186 |
◊ |
L |
x,y,z |
1_555 |
1 |
1 |
11787 |
1.1 |
-0.2 |
0.702 |
0 |
0 |
0 |
0.000 |
|